SCHEMBL4308952

SCHEMBL4308952

Cc1cccnc1CNc1cc2c(=O)c3cc(-c4cnn(C)c4)cnc3ccc2cn1

nearest known ligand 0.57

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
MET P08581 20/20 0.57
MST1R Q04912 3/20 0.54
CYP3A4 P08684 1/20 0.54
CYP2D6 P10635 1/20 0.54
CYP2C9 P11712 1/20 0.54
FECH P22830 1/20 0.54
KCNH2 Q12809 2/20 0.52

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL2448783 0.89 MET (0.67) METMST1RCYP3A4CYP2D6CYP2C9
SCHEMBL4316394 0.87 MET (0.56) METMST1RCYP3A4CYP2D6CYP2C9
SCHEMBL4308766 0.82 MTOR (0.43) METMST1RCYP3A4CYP2D6CYP2C9
SCHEMBL4312490 0.82 MET (0.45) METMST1RCYP3A4CYP2D6CYP2C9
SCHEMBL13859978 0.82 PDE10A (0.40) METMST1RCYP3A4CYP2D6CYP2C9
SCHEMBL399354 0.81 MET (0.78) METMST1RCYP3A4CYP2D6CYP2C9
SCHEMBL4322496 0.80 MET (0.55) METMST1RCYP3A4CYP2D6CYP2C9
SCHEMBL4313284 0.80 MET (0.44) METMST1R
SCHEMBL5067593 0.80 MET (0.39) METMST1RCYP3A4CYP2D6CYP2C9
SCHEMBL4307875 0.78 FGFR3 (0.56) METMST1RKCNH2

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 5 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20090131423-A1 Tyrosine Kinase Inhibitors MERCK & CO., INC. (US) 2009-05-21 US claimed
US-20090131423-A1 Tyrosine Kinase Inhibitors MERCK & CO., INC. (US) 2009-05-21 US disclosed
US-20090131423-A1 Tyrosine Kinase Inhibitors MERCK & CO., INC. (US) 2009-05-21 US disclosed
US-20090131423-A1 Tyrosine Kinase Inhibitors MERCK & CO., INC. (US) 2009-05-21 US disclosed
WO-2007050383-A2 TYROSINE KINASE INHIBITORS MERCK & CO., INC. (US) 2007-05-03 WO disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20090131423-A1 Tyrosine Kinase Inhibitors ABL1, ERBB2, MET MET 3/4885MST1R 273/4885CYP3A4 4606/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.